On the Importance of Halogen and Chalcogen Bonds in the Solid State of Nucleic Acids: A Combined Crystallographic and Theoretical Perspective

On the Importance of Halogen and Chalcogen Bonds in the Solid State of Nucleic Acids: A Combined Crystallographic and Theoretical Perspective

In this work, intra- and intermolecular halogen and chalcogen bonds (HlgBs and ChBs, respectively) present in the solid state of nucleic acids (NAs) have been studied at the RI-MP2/def2-TZVP level of theory. To achieve this, a Protein Data Bank (PDB) survey was carried out, revealing a series of str...

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Bibliographic Details
Main Authors: María de las Nieves Piña, Antonio Bauzá
Format: Article
Language:English
Published: MDPI AG 2023-08-01
Series:International Journal of Molecular Sciences
Subjects:
nucleic acids
PDB survey
solid state chemistry
halogen bonding
chalcogen bonding
theoretical study
Online Access:https://www.mdpi.com/1422-0067/24/17/13035

Internet

https://www.mdpi.com/1422-0067/24/17/13035

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